SCHEMBL6963975

SCHEMBL6963975

CCCC[Si]([O])(CCCC)c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.41
EPHX2 P34913 2/20 0.39
PKM P14618 1/20 0.39
NAAA Q02083 1/20 0.38
TSHR P16473 2/20 0.37
CES2 O00748 2/20 0.37
CES1 P23141 2/20 0.37
HTT P42858 2/20 0.37
TDP1 Q9NUW8 1/20 0.36
EPHX1 P07099 3/20 0.36
ALDH1A1 P00352 1/20 0.36
LMNA P02545 1/20 0.36
MAPT P10636 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL6965425 0.94 EPHX2 (0.42) SMN1; SMN2EPHX2PKMNAAACES2
SCHEMBL6972289 0.92 EPHX2 (0.44) SMN1; SMN2EPHX2PKMNAAACES2
SCHEMBL6957948 0.86 NAAA (0.36) SMN1; SMN2EPHX2PKMNAAATSHR
SCHEMBL599107 0.83 NAAA (0.38) SMN1; SMN2EPHX2NAAATSHRCES2
SCHEMBL3886636 0.77 TSHR (0.38) SMN1; SMN2NAAATSHRCES2CES1
SCHEMBL27604670 0.77 TSHR (0.38) SMN1; SMN2NAAATSHRCES2CES1
SCHEMBL6963558 0.77 NAAA (0.41) EPHX2PKMNAAACES2CES1
SCHEMBL2483998 0.77 TP53 (0.38) SMN1; SMN2TSHRCES2CES1ALDH1A1
SCHEMBL1989760 0.76 LTA4H (0.35) SMN1; SMN2NAAATSHRCES2CES1
SCHEMBL5801979 0.76 NR1H2 (0.53) NAAATSHRMAPT

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1329160-A2 4-ACYLAMINOPYRAZOLE DERIVATIVES Sankyo Company, Limited (JP) 2003-07-23 EP disclosed